- InChI
- InChI=1S/C13H15ClO4/c1-4-17-11(15)13(2,3)12(16)18-10-7-5-9(14)6-8-10/h5-8H,4H2,1-3H3
- InChI Key
- YARLDFPKAPGMBN-UHFFFAOYSA-N
- Formula
- C13H15ClO4
- SMILES
-
CCOC(=O)C(C)(C)C(=O)Oc1ccc(Cl)
cc1 - Molecular Weight1
- 270.71
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6126 | Relay (1.0) Calculated Property | |
| ΔfG° | -315.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -728.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.59 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.835 | Crippen Calculated Property | |
| McVol | 197.390 | ml/mol | McGowan Calculated Property |
| Pc | 2320.31 | kPa | Joback Calculated Property |
| Inp | 1727.00 | NIST | |
| Tboil | 568.44 | K | Relay (1.0) Calculated Property |
| Tc | 779.44 | K | Relay (1.0) Calculated Property |
| Tfus | 309.67 | K | Relay (1.0) Calculated Property |
| Vc | 0.715 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [515.80; 580.84] | J/mol×K | [715.28; 938.11] | 
|
| Cp,gas | 515.80 | J/mol×K | 715.28 | Joback Calculated Property |
| Cp,gas | 529.03 | J/mol×K | 752.42 | Joback Calculated Property |
| Cp,gas | 541.26 | J/mol×K | 789.56 | Joback Calculated Property |
| Cp,gas | 552.53 | J/mol×K | 826.69 | Joback Calculated Property |
| Cp,gas | 562.86 | J/mol×K | 863.83 | Joback Calculated Property |
| Cp,gas | 572.28 | J/mol×K | 900.97 | Joback Calculated Property |
| Cp,gas | 580.84 | J/mol×K | 938.11 | Joback Calculated Property |
| η | [0.0001016; 0.0008920] | Pa×s | [451.87; 715.28] |
|
| η | 0.0008920 | Pa×s | 451.87 | Joback Calculated Property |
| η | 0.0005291 | Pa×s | 495.77 | Joback Calculated Property |
| η | 0.0003417 | Pa×s | 539.67 | Joback Calculated Property |
| η | 0.0002357 | Pa×s | 583.58 | Joback Calculated Property |
| η | 0.0001712 | Pa×s | 627.48 | Joback Calculated Property |
| η | 0.0001297 | Pa×s | 671.38 | Joback Calculated Property |
| η | 0.0001016 | Pa×s | 715.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 4-chlorophenyl ethyl ester.
Sources
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